3-[[1-(2,3-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-phenyl-propanamide

Systemtic Name: 3-[[1-(2,3-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: 3-[1-(2,3-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-phenyl-propanamide CAS Name: 3-[[1-(2,3-dimethylphenyl)-5-tetrazolyl]thio]-N-phenylpropanamide IUPAC Name: 3-[1-(2,3-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-phenylpropanamide Traditional Name: 3-[[1-(2,3-dimethylphenyl)tetrazol-5-yl]thio]-N-phenyl-propionamide Formula: C18H19N5OS MolecularWeight: 353.44136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2C(=NN=N2)SCCC(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2C(=NN=N2)SCCC(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C18H19N5OS/c1-13-7-6-10-16(14(13)2)23-18(20-21-22-23)25-12-11-17(24)19-15-8-4-3-5-9-15/h3-10H,11-12H2,1-2H3,(H,19,24)